N-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide

C17H20N4O — CID 119697450

IUPACN-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide
SMILESO=C(CC1CCNCC1)Nc1cnc(-c2ccccc2)nc1
InChIInChI=1S/C17H20N4O/c22-16(10-13-6-8-18-9-7-13)21-15-11-19-17(20-12-15)14-4-2-1-3-5-14/h1-5,11-13,18H,6-10H2,(H,21,22)
InChIKeyNZKCCHMUCYVFKY-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.47
Rot. Bonds4

About N-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide

N-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide (PubChem CID 119697450) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is N-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide.

Molecular Properties

Compound NameN-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide
PubChem CID119697450
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC NameN-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide
SMILESO=C(CC1CCNCC1)Nc1cnc(-c2ccccc2)nc1
InChIInChI=1S/C17H20N4O/c22-16(10-13-6-8-18-9-7-13)21-15-11-19-17(20-12-15)14-4-2-1-3-5-14/h1-5,11-13,18H,6-10H2,(H,21,22)
InChIKeyNZKCCHMUCYVFKY-UHFFFAOYSA-N
XLogP2.47
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-phenylphenyl)-2-piperidin-4-ylacetamide
CID 67362104
N-(2-phenylpyrimidin-5-yl)propanamide
CID 53014772
2-chloro-N-(2-phenylpyrimidin-5-yl)acetamide
CID 43699755
2-piperidin-4-yl-N-pyridin-2-ylacetamide;dihydrochloride
CID 119827189
N-(4-phenylmethoxyphenyl)-2-piperidin-4-ylacetamide;hydrochloride
CID 119669311
2-cyclopropyl-N-phenylacetamide
CID 60753326
N-(6-fluoro-3-pyridinyl)-2-pyrrolidin-3-ylacetamide
CID 104954698
2-phenoxy-N-(2-phenylpyrimidin-5-yl)acetamide
CID 17407421
2-methylsulfanyl-N-(2-phenylpyrimidin-5-yl)acetamide
CID 47128547
N-pyrimidin-5-yl-2-pyrrolidin-3-ylacetamide
CID 107588558
N-(3,4-dichlorophenyl)-2-piperidin-4-ylacetamide;hydrochloride
CID 119670897
N-(3,5-dimethoxyphenyl)-2-piperidin-4-ylacetamide
CID 24703765

Frequently Asked Questions

What is the IUPAC name of N-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide?
The IUPAC name of N-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide (CID 119697450) is N-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide.
What is the SMILES notation for N-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide?
The canonical SMILES for N-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide is O=C(CC1CCNCC1)Nc1cnc(-c2ccccc2)nc1.
What is the InChIKey of N-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide?
The InChIKey is NZKCCHMUCYVFKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c22-16(10-13-6-8-18-9-7-13)21-15-11-19-17(20-12-15)14-4-2-1-3-5-14/h1-5,11-13,18H,6-10H2,(H,21,22).
What are the key properties of N-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide?
N-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide has a molecular weight of 296.37 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenylpyrimidin-5-yl)-2-piperidin-4-ylacetamide is sourced from PubChem (CID 119697450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).